Geometry & MOs

Info

ID:	407850
PubChem CID:	135080605
Reduced:	O2C13H14 (1)
Stoich.:	A2B13C14 (1)
Weight, g/mol:	232.182715
ΔH_f, kcal/mol:	-59.78
Dipole, Da:	4.79
IP(EA), eV:	-9.53(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-5-ethenyl-1-phenyloctan-4-ol

Drug info:

PubChemData

Smile

C1CC(=O)OC1C/C=C/C2=CC=CC=C2

DOS

IR

Vibrations